Chemical Properties of Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)- (CAS 6876-13-7)

Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)-

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InChI
InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8-,9+/m0/s1
InChI Key
XOKSLPVRUOBDEW-XHNCKOQMSA-N
Formula
C10H18
SMILES
CC1CCC2CC1C2(C)C
Molecular Weight1
138.25
CAS
6876-13-7
Other Names
  • 2,6,6-Trimethyl-bicyclo[3.1.1]heptane, cis
  • 2,6,6-Trimethylbicyclo[3.1.1]heptane, (1«alpha»,2«beta»,5«alpha»)-
  • Pinane, cis
  • cis-Pinane
  • (1«alpha»,2«beta»,5«alpha»)-2,6,6-trimethylbicyclo[3.1.1]heptane
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Physical Properties

Property Value Unit Source
Δf 121.81 kJ/mol Joback Calculated Property
Δfgas -135.73 kJ/mol Joback Calculated Property
Δfus 11.67 kJ/mol Joback Calculated Property
Δvap 36.08 kJ/mol Joback Calculated Property
log10WS -2.83 Crippen Calculated Property
logPoct/wat 3.079 Crippen Calculated Property
McVol 130.040 ml/mol McGowan Calculated Property
Pc 2729.71 kPa Joback Calculated Property
Inp [968.00; 1014.00]   Show Hide
Inp Outlier 1014.00 NIST
Inp 978.00 NIST
Inp 971.00 NIST
Inp 968.00 NIST
Inp 993.00 NIST
Inp 986.00 NIST
Inp 987.00 NIST
Inp 977.00 NIST
Inp 986.00 NIST
Inp 968.00 NIST
I [1075.00; 1103.00]   Show Hide
I 1082.00 NIST
I 1103.00 NIST
I 1075.00 NIST
I 1075.00 NIST
Tboil 442.00 ± 2.00 K NIST
Tc 642.10 K Joback Calculated Property
Tfus 250.24 K Joback Calculated Property
Vc 0.497 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [287.02; 389.91] J/mol×K [436.85; 642.10] Show Hide
Cp,gas 287.02 J/mol×K 436.85 Joback Calculated Property
Cp,gas 307.28 J/mol×K 471.06 Joback Calculated Property
Cp,gas 326.14 J/mol×K 505.27 Joback Calculated Property
Cp,gas 343.70 J/mol×K 539.47 Joback Calculated Property
Cp,gas 360.10 J/mol×K 573.68 Joback Calculated Property
Cp,gas 375.46 J/mol×K 607.89 Joback Calculated Property
Cp,gas 389.91 J/mol×K 642.10 Joback Calculated Property

Similar Compounds

(-)-trans-Pinane. Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-. Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, [1S-(1«alpha»,2«beta»,5«alpha»)]-. Caryophyllane-b. Caryophyllane-a. Caryophyllane. Caryophyllane-d. Caryophyllane-c. 1,1,4a-Trimethyl-7,8a-(«alpha»-methylethano)-tetradecahydro-phenanthrene. Copaane. Cyclobutane, 1,1-dimethyl-2-octyl-. 4«alpha»H,5«alpha»H-Eudesmane. Perhydrophenanthrene, 1B-(3R,7-dimethyloctyl)-2A,4bB,8,8,10aB-pentamethyl. onocerane-II. Decahydro-1,1,4a,5,6-pentamethylnaphthalene.

Find more compounds similar to Bicyclo[3.1.1]heptane, 2,6,6-trimethyl-, (1«alpha»,2«beta»,5«alpha»)-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.